#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fr0 s THR 655 N 0.00 4.29 0.00 4.28 2.01 -1.26 -4.60 115.64 120.36 1fr0 s THR 655 Ca 0.00 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 60.95 1fr0 s THR 655 Cb 0.00 -4.91 0.00 0.00 0.01 0.00 0.00 72.50 67.60 1fr0 s THR 655 CO 0.00 -1.72 0.82 -1.84 -0.69 0.00 0.00 174.62 171.19 1fr0 n GLU 656 N 7.80 0.00 -3.75 4.92 0.28 -1.26 -5.06 120.64 123.57 1fr0 n GLU 656 Ca 0.25 -0.78 -0.36 0.00 -0.16 0.00 0.00 57.16 56.11 1fr0 n GLU 656 Cb 0.50 -0.45 -0.07 0.00 1.43 0.00 0.00 31.44 32.84 1fr0 n GLU 656 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1fr0 s GLU 657 N 0.00 3.95 -1.02 3.44 2.12 -1.26 -4.49 118.70 121.44 1fr0 s GLU 657 Ca 0.00 -0.15 -0.05 0.00 0.36 0.00 0.00 54.97 55.13 1fr0 s GLU 657 Cb 0.00 -3.34 -0.06 0.00 0.26 0.00 0.00 34.13 30.99 1fr0 s GLU 657 CO 0.00 0.46 0.88 -1.71 -0.54 0.00 0.00 175.26 174.35 1fr0 n ASN 658 N 2.99 -5.99 -1.34 -1.70 2.85 -1.26 -4.90 115.26 105.90 1fr0 n ASN 658 Ca -0.17 -0.67 0.08 0.00 -0.11 0.00 0.00 54.58 53.72 1fr0 n ASN 658 Cb 0.53 -4.99 0.30 0.00 1.24 0.00 0.00 39.78 36.86 1fr0 n ASN 658 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1fr0 n SER 659 N -3.14 3.95 0.00 1.20 7.64 -1.26 -4.74 113.62 117.27 1fr0 n SER 659 Ca -0.09 -2.30 0.00 0.00 1.01 0.00 0.00 58.87 57.50 1fr0 n SER 659 Cb 0.62 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1fr0 n SER 659 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1fr0 n LYS 660 N 1.02 0.00 -1.14 1.43 4.01 -1.26 -1.95 118.16 120.26 1fr0 n LYS 660 Ca 0.22 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.67 1fr0 n LYS 660 Cb 0.72 -0.49 -0.10 0.00 -0.51 0.00 0.00 35.03 34.65 1fr0 n LYS 660 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1fr0 n SER 661 N 0.00 1.75 0.00 4.39 3.41 -1.26 -2.59 113.62 119.32 1fr0 n SER 661 Ca 0.00 -2.57 0.00 0.00 -0.26 0.00 0.00 58.87 56.04 1fr0 n SER 661 Cb 0.00 -1.12 0.00 0.00 -0.26 0.00 0.00 64.21 62.83 1fr0 n SER 661 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1fr0 n GLU 662 N 7.84 0.00 0.00 4.33 4.07 -1.13 -4.93 120.64 130.82 1fr0 n GLU 662 Ca 0.46 0.00 0.14 0.00 -0.06 0.00 0.00 57.16 57.70 1fr0 n GLU 662 Cb 0.43 0.00 0.66 0.00 -0.06 0.00 0.00 31.44 32.48 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1fr0 n ALA 663 N -0.40 2.59 -0.10 4.31 0.00 -0.82 -3.60 120.51 122.48 1fr0 n ALA 663 Ca 0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 1fr0 n ALA 663 Cb 0.00 -1.42 -0.16 0.00 0.00 0.00 0.00 19.45 17.87 1fr0 n ALA 663 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fr0 n LEU 664 N -1.25 0.19 -4.15 0.00 4.77 -1.26 -4.23 117.00 111.06 1fr0 n LEU 664 Ca 0.12 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 55.99 1fr0 n LEU 664 Cb 0.28 0.41 -0.10 0.00 -2.33 0.00 0.00 43.42 41.67 1fr0 n LEU 664 CO 0.25 0.52 -0.38 -1.48 -1.33 0.00 0.00 177.39 174.97 1fr0 s LEU 665 N -5.54 2.50 -0.45 2.23 2.34 -1.24 -2.11 118.68 116.40 1fr0 s LEU 665 Ca -0.11 -0.99 -0.27 0.00 0.06 0.00 0.00 54.13 52.82 1fr0 s LEU 665 Cb 0.06 -0.04 0.03 0.00 -0.56 0.00 0.00 46.19 45.68 1fr0 s LEU 665 CO 0.81 -0.47 1.01 -0.62 -1.06 0.00 0.00 176.35 176.02 1fr0 s ASP 666 N -2.96 6.59 0.03 1.48 -1.08 -0.85 -4.59 116.67 115.29 1fr0 s ASP 666 Ca 0.10 0.35 -0.20 0.00 -0.52 0.00 0.00 52.55 52.28 1fr0 s ASP 666 Cb 0.05 -2.49 -0.15 0.00 -1.46 0.00 0.00 42.92 38.86 1fr0 s ASP 666 CO -0.05 -1.10 1.31 0.40 0.52 0.00 0.00 175.17 176.25 1fr0 h ILE 667 N 6.09 1.36 -0.18 4.11 5.03 -1.92 -1.20 117.51 130.81 1fr0 h ILE 667 Ca -0.23 -1.41 -0.16 0.00 -0.12 0.00 0.00 64.86 62.93 1fr0 h ILE 667 Cb 1.07 1.97 -0.01 0.00 -3.03 0.00 0.00 36.82 36.82 1fr0 h ILE 667 CO 1.06 0.41 -0.56 1.55 -0.68 0.00 0.00 178.15 179.94 1fr0 h PRO 668 N -0.03 0.55 -0.02 2.37 0.13 -1.99 -2.72 132.00 130.29 1fr0 h PRO 668 Ca 0.01 -0.35 -0.15 0.00 -0.87 0.00 0.00 66.00 64.64 1fr0 h PRO 668 Cb 0.75 0.04 0.01 0.00 0.13 0.00 0.00 31.00 31.94 1fr0 h PRO 668 CO 0.04 0.96 -0.59 1.98 -0.23 0.00 0.00 178.00 180.17 1fr0 h MET 669 N 0.42 0.43 -0.58 0.86 4.05 -1.97 -2.72 114.93 115.42 1fr0 h MET 669 Ca 0.01 -0.44 0.05 0.00 -0.28 0.00 0.00 59.70 59.04 1fr0 h MET 669 Cb 1.10 0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 31.97 1fr0 h MET 669 CO 0.10 1.09 0.31 -0.07 0.23 0.00 0.00 176.91 178.58 1fr0 h LEU 670 N -0.07 0.47 0.76 3.39 3.38 -1.26 -0.37 115.31 121.61 1fr0 h LEU 670 Ca -0.07 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1fr0 h LEU 670 Cb 1.29 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.98 1fr0 h LEU 670 CO 0.12 0.32 -0.37 -0.08 0.09 0.00 0.00 178.44 178.51 1fr0 h GLU 671 N 0.60 -0.99 -0.78 1.13 4.22 -1.53 -2.56 114.58 114.66 1fr0 h GLU 671 Ca 0.25 0.07 0.18 0.00 0.08 0.00 0.00 59.36 59.94 1fr0 h GLU 671 Cb 0.14 0.22 -0.14 0.00 0.50 0.00 0.00 28.75 29.47 1fr0 h GLU 671 CO -0.16 -0.66 0.00 1.96 -2.18 0.00 0.00 179.01 177.97 1fr0 h GLN 672 N -1.06 0.09 -0.55 1.92 1.08 -1.34 0.19 115.11 115.43 1fr0 h GLN 672 Ca -0.10 -0.01 0.11 0.00 -1.45 0.00 0.00 58.65 57.20 1fr0 h GLN 672 Cb 0.79 -0.02 -0.10 0.00 -0.05 0.00 0.00 27.48 28.09 1fr0 h GLN 672 CO 0.17 0.06 -0.12 1.88 -0.95 0.00 0.00 178.83 179.87 1fr0 h TYR 673 N 0.09 -0.27 -0.56 2.96 -1.99 -0.88 0.68 116.97 117.01 1fr0 h TYR 673 Ca 0.43 0.05 0.11 0.00 2.00 0.00 0.00 58.73 61.32 1fr0 h TYR 673 Cb 0.76 0.20 -0.03 0.00 2.00 0.00 0.00 36.73 39.67 1fr0 h TYR 673 CO -0.44 -0.23 0.38 -0.07 -0.00 0.00 0.00 178.16 177.80 1fr0 h LEU 674 N 0.01 0.24 -0.40 3.88 3.38 -0.22 0.18 115.31 122.39 1fr0 h LEU 674 Ca 0.27 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 58.08 1fr0 h LEU 674 Cb 0.41 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1fr0 h LEU 674 CO -0.56 0.14 -0.76 -0.08 0.09 0.00 0.00 178.44 177.27 1fr0 h GLU 675 N 0.26 0.00 0.00 1.13 4.22 0.69 0.82 114.58 121.71 1fr0 h GLU 675 Ca 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.70 1fr0 h GLU 675 Cb 0.68 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1fr0 h GLU 675 CO -0.06 0.76 -0.04 -0.07 -2.18 0.00 0.00 179.01 177.42 1fr0 h LEU 676 N 0.00 0.00 0.00 1.64 3.38 0.15 -3.43 115.31 117.06 1fr0 h LEU 676 Ca -0.01 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.24 1fr0 h LEU 676 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1fr0 h LEU 676 CO 0.10 0.88 -0.75 1.33 0.09 0.00 0.00 178.44 180.09 1fr0 n VAL 677 N -4.65 0.00 -0.07 1.22 0.24 0.35 -5.10 118.33 110.32 1fr0 n VAL 677 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.22 1fr0 n VAL 677 Cb 0.36 0.07 0.00 0.00 -1.47 0.00 0.00 33.84 32.80 1fr0 n VAL 677 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fr0 n GLY 678 N 2.01 -1.75 0.00 7.63 0.00 0.28 -4.31 105.19 109.06 1fr0 n GLY 678 Ca 0.00 -2.03 0.11 0.00 0.00 0.00 0.00 46.02 44.10 1fr0 n GLY 678 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fr0 n PRO 679 N 0.00 0.65 0.00 1.61 -0.04 -1.26 -3.93 135.00 132.04 1fr0 n PRO 679 Ca 0.00 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1fr0 n PRO 679 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1fr0 n PRO 679 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1fr0 n LYS 680 N -1.04 0.00 -0.17 0.54 5.02 -1.26 -0.97 118.16 120.28 1fr0 n LYS 680 Ca 0.16 0.40 -0.02 0.00 -2.02 0.00 0.00 58.31 56.83 1fr0 n LYS 680 Cb 0.09 -1.21 0.08 0.00 -0.02 0.00 0.00 35.03 33.97 1fr0 n LYS 680 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1fr0 h LEU 681 N 0.00 0.14 0.00 -0.35 5.85 -1.83 1.00 115.31 120.13 1fr0 h LEU 681 Ca 0.00 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1fr0 h LEU 681 Cb 0.00 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1fr0 h LEU 681 CO 0.00 0.10 -0.09 0.40 -0.34 0.00 0.00 178.44 178.51 1fr0 h ILE 682 N 0.34 0.76 -0.19 4.05 2.04 -1.68 -0.85 117.51 121.98 1fr0 h ILE 682 Ca 0.26 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.99 1fr0 h ILE 682 Cb 0.31 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1fr0 h ILE 682 CO -0.28 0.00 -0.38 0.00 0.00 0.00 0.00 178.15 177.48 1fr0 h THR 683 N -0.16 1.33 0.23 -0.27 1.03 -0.53 -2.27 112.91 112.28 1fr0 h THR 683 Ca 0.03 -1.62 -0.01 0.00 -0.01 0.00 0.00 66.41 64.81 1fr0 h THR 683 Cb 0.21 1.89 -0.01 0.00 -1.07 0.00 0.00 68.15 69.16 1fr0 h THR 683 CO -0.09 0.50 -0.28 -0.78 -0.01 0.00 0.00 175.52 174.86 1fr0 h ASP 684 N 0.27 -0.77 -0.83 0.00 3.58 0.12 0.21 116.42 119.00 1fr0 h ASP 684 Ca 0.01 0.07 0.16 0.00 0.42 0.00 0.00 57.03 57.68 1fr0 h ASP 684 Cb 0.98 0.26 -0.06 0.00 1.72 0.00 0.00 39.33 42.23 1fr0 h ASP 684 CO 0.09 -0.35 0.55 1.23 -2.88 0.00 0.00 179.24 177.87 1fr0 h GLY 685 N -0.52 0.90 1.19 -0.78 0.00 -1.26 0.12 103.07 102.72 1fr0 h GLY 685 Ca -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1fr0 h GLY 685 CO -0.06 0.06 0.46 -2.00 0.00 0.00 0.00 176.54 175.00 1fr0 h LEU 686 N 0.50 0.95 0.31 3.11 5.85 -0.69 -0.08 115.31 125.26 1fr0 h LEU 686 Ca 0.42 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.06 1fr0 h LEU 686 Cb 0.87 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1fr0 h LEU 686 CO -0.16 0.74 -0.15 0.00 -0.34 0.00 0.00 178.44 178.53 1fr0 h ALA 687 N 1.42 -0.41 -0.33 1.25 0.00 0.13 0.17 119.26 121.49 1fr0 h ALA 687 Ca 0.28 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1fr0 h ALA 687 Cb -0.03 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1fr0 h ALA 687 CO -0.05 -0.61 0.20 0.28 0.00 0.00 0.00 179.25 179.07 1fr0 h VAL 688 N -0.65 1.09 0.11 0.00 2.07 -1.30 -1.89 116.25 115.69 1fr0 h VAL 688 Ca -0.04 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1fr0 h VAL 688 Cb 0.46 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1fr0 h VAL 688 CO 0.07 0.10 -0.05 0.15 0.02 0.00 0.00 177.57 177.85 1fr0 h PHE 689 N 0.45 -0.14 -0.01 1.57 3.57 -0.81 -2.80 116.94 118.77 1fr0 h PHE 689 Ca 0.12 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1fr0 h PHE 689 Cb -0.02 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 1fr0 h PHE 689 CO 0.00 0.35 0.16 1.05 -2.23 0.00 0.00 178.31 177.64 1fr0 h GLU 690 N -0.87 0.00 0.03 1.11 4.11 -0.53 0.27 114.58 118.70 1fr0 h GLU 690 Ca -0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.41 1fr0 h GLU 690 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1fr0 h GLU 690 CO 0.03 0.00 -0.02 0.87 0.07 0.00 0.00 179.01 179.96 1fr0 h LYS 691 N 0.00 -0.04 -0.61 1.06 1.57 -1.29 -3.31 116.57 113.94 1fr0 h LYS 691 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1fr0 h LYS 691 Cb 0.32 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1fr0 h LYS 691 CO -0.00 0.39 0.00 -1.33 -0.57 0.00 0.00 179.45 177.94 1fr0 n MET 692 N -4.75 2.43 0.36 3.15 2.81 -0.96 -4.33 117.12 115.85 1fr0 n MET 692 Ca -0.05 -1.41 -0.17 0.00 -1.81 0.00 0.00 57.70 54.26 1fr0 n MET 692 Cb 0.22 -1.62 -0.09 0.00 -0.71 0.00 0.00 33.22 31.02 1fr0 n MET 692 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 1fr0 h MET 693 N 1.98 -0.88 -0.25 0.03 2.86 -0.57 0.86 114.93 118.96 1fr0 h MET 693 Ca 0.00 0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.58 1fr0 h MET 693 Cb 0.90 0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 1fr0 h MET 693 CO 0.14 -0.56 -0.34 -1.00 1.06 0.00 0.00 176.91 176.20 1fr0 h PRO 694 N -1.02 0.55 0.00 -0.22 0.13 -1.82 -2.45 132.00 127.18 1fr0 h PRO 694 Ca -0.09 -0.25 -0.05 0.00 -0.87 0.00 0.00 66.00 64.73 1fr0 h PRO 694 Cb 0.73 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1fr0 h PRO 694 CO 0.15 0.82 -0.24 0.78 -0.23 0.00 0.00 178.00 179.28 1fr0 h GLY 695 N 1.05 0.00 0.41 1.56 0.00 -1.76 -1.66 103.07 102.67 1fr0 h GLY 695 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 1fr0 h GLY 695 CO 0.07 0.00 -0.16 -0.97 0.00 0.00 0.00 176.54 175.48 1fr0 h TYR 696 N 0.00 -0.41 -0.25 5.60 0.05 -0.36 -2.82 116.97 118.79 1fr0 h TYR 696 Ca -0.00 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.84 1fr0 h TYR 696 Cb 0.50 0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.37 1fr0 h TYR 696 CO 0.00 -0.13 0.19 -0.39 -1.05 0.00 0.00 178.16 176.79 1fr0 h VAL 697 N -1.03 0.80 0.61 -2.88 -1.51 -1.44 -1.57 116.25 109.23 1fr0 h VAL 697 Ca -0.04 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.40 1fr0 h VAL 697 Cb 0.46 0.86 0.01 0.00 -2.13 0.00 0.00 31.29 30.49 1fr0 h VAL 697 CO 0.07 0.00 -0.29 0.28 -1.23 0.00 0.00 177.57 176.40 1fr0 h SER 698 N 0.00 -0.69 -0.90 4.19 0.02 -1.27 -1.10 113.55 113.81 1fr0 h SER 698 Ca 0.12 0.02 0.17 0.00 -0.84 0.00 0.00 61.79 61.27 1fr0 h SER 698 Cb 0.51 0.18 -0.07 0.00 0.14 0.00 0.00 62.40 63.15 1fr0 h SER 698 CO -0.00 -0.46 0.58 0.58 -1.14 0.00 0.00 176.83 176.39 1fr0 h VAL 699 N -0.88 0.76 -0.09 2.27 2.07 -1.22 -0.54 116.25 118.62 1fr0 h VAL 699 Ca -0.08 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1fr0 h VAL 699 Cb 0.62 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1fr0 h VAL 699 CO 0.14 0.10 -0.05 0.25 0.02 0.00 0.00 177.57 178.03 1fr0 h LEU 700 N 0.57 -0.16 -0.41 2.57 5.85 -1.00 -2.31 115.31 120.41 1fr0 h LEU 700 Ca 0.46 0.04 0.08 0.00 0.84 0.00 0.00 57.88 59.30 1fr0 h LEU 700 Cb 0.92 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.97 1fr0 h LEU 700 CO -0.21 -0.07 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.46 1fr0 h GLU 701 N -0.04 0.07 -0.65 1.25 3.07 0.21 -1.05 114.58 117.43 1fr0 h GLU 701 Ca 0.05 -0.00 0.14 0.00 -0.50 0.00 0.00 59.36 59.05 1fr0 h GLU 701 Cb 0.12 -0.02 -0.11 0.00 -0.84 0.00 0.00 28.75 27.90 1fr0 h GLU 701 CO -0.12 0.04 -0.03 1.03 -1.40 0.00 0.00 179.01 178.53 1fr0 h SER 702 N 0.07 -0.36 0.45 1.42 0.87 -1.11 -1.15 113.55 113.73 1fr0 h SER 702 Ca 0.20 0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.91 1fr0 h SER 702 Cb 0.30 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1fr0 h SER 702 CO -0.37 -0.15 -0.24 0.78 -0.53 0.00 0.00 176.83 176.32 1fr0 h ASN 703 N 0.09 -0.57 -1.17 6.23 2.35 -0.83 -1.70 115.58 119.98 1fr0 h ASN 703 Ca 0.34 0.02 0.33 0.00 -0.55 0.00 0.00 56.30 56.45 1fr0 h ASN 703 Cb 0.56 0.15 -0.07 0.00 0.05 0.00 0.00 38.32 39.02 1fr0 h ASN 703 CO -0.59 -0.39 0.81 0.25 -1.65 0.00 0.00 177.43 175.87 1fr0 h LEU 704 N -0.64 0.14 -0.49 1.61 5.85 -0.47 0.42 115.31 121.74 1fr0 h LEU 704 Ca -0.06 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1fr0 h LEU 704 Cb 0.50 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1fr0 h LEU 704 CO 0.09 0.01 0.05 0.74 -0.34 0.00 0.00 178.44 178.99 1fr0 h THR 705 N 0.11 1.25 -0.21 1.05 2.02 -0.30 -2.07 112.91 114.77 1fr0 h THR 705 Ca 0.59 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1fr0 h THR 705 Cb 2.10 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 1fr0 h THR 705 CO -0.11 0.35 0.00 0.00 0.37 0.00 0.00 175.52 176.13 1fr0 n ALA 706 N -2.41 2.57 -3.38 6.16 0.00 0.14 -4.87 120.51 118.72 1fr0 n ALA 706 Ca 0.01 -0.43 -0.19 0.00 0.00 0.00 0.00 53.44 52.83 1fr0 n ALA 706 Cb 0.27 -1.00 0.07 0.00 0.00 0.00 0.00 19.45 18.80 1fr0 n ALA 706 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fr0 n GLN 707 N 0.16 -6.51 -1.63 0.00 1.13 -0.66 -4.88 117.38 104.97 1fr0 n GLN 707 Ca 0.08 0.72 -0.34 0.00 -1.94 0.00 0.00 57.00 55.52 1fr0 n GLN 707 Cb 0.27 -5.41 -0.04 0.00 0.11 0.00 0.00 30.24 25.17 1fr0 n GLN 707 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1fr0 n ASP 708 N -2.53 7.56 -0.32 1.08 8.00 -0.80 -4.75 116.55 124.79 1fr0 n ASP 708 Ca -0.07 -2.97 0.02 0.00 0.71 0.00 0.00 54.79 52.48 1fr0 n ASP 708 Cb 0.58 -1.38 0.09 0.00 -0.02 0.00 0.00 41.12 40.39 1fr0 n ASP 708 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1fr0 h LYS 709 N 4.16 -0.02 0.68 -1.24 3.64 -1.90 -0.87 116.57 121.03 1fr0 h LYS 709 Ca 0.62 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.97 1fr0 h LYS 709 Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1fr0 h LYS 709 CO 1.28 -0.01 -0.49 0.87 -2.27 0.00 0.00 179.45 178.82 1fr0 h LYS 710 N -0.02 -1.08 -0.98 1.90 1.57 -2.00 -1.45 116.57 114.51 1fr0 h LYS 710 Ca 0.39 0.07 0.31 0.00 -1.87 0.00 0.00 60.65 59.55 1fr0 h LYS 710 Cb 0.63 0.25 -0.15 0.00 0.08 0.00 0.00 32.23 33.04 1fr0 h LYS 710 CO -0.91 -0.72 0.51 0.78 -0.57 0.00 0.00 179.45 178.53 1fr0 h GLY 711 N -1.12 1.94 1.69 3.86 0.00 -1.60 0.66 103.07 108.50 1fr0 h GLY 711 Ca -0.09 -0.20 -0.12 0.00 0.00 0.00 0.00 47.33 46.92 1fr0 h GLY 711 CO 0.04 -0.47 -0.43 -2.22 0.00 0.00 0.00 176.54 173.46 1fr0 h ILE 712 N 0.30 1.32 -0.19 2.60 2.04 -0.68 -2.37 117.51 120.53 1fr0 h ILE 712 Ca 0.70 -1.59 -0.10 0.00 1.00 0.00 0.00 64.86 64.88 1fr0 h ILE 712 Cb 1.57 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 39.31 1fr0 h ILE 712 CO -0.62 0.48 -0.30 0.58 0.00 0.00 0.00 178.15 178.29 1fr0 h VAL 713 N 0.28 1.27 0.04 1.67 2.07 0.14 -0.24 116.25 121.48 1fr0 h VAL 713 Ca 0.02 -1.32 -0.06 0.00 0.82 0.00 0.00 66.70 66.17 1fr0 h VAL 713 Cb 0.88 1.46 0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1fr0 h VAL 713 CO 0.07 0.41 -0.25 -0.33 0.02 0.00 0.00 177.57 177.49 1fr0 h GLU 714 N 0.32 0.10 0.00 1.57 5.08 -1.27 -3.14 114.58 117.24 1fr0 h GLU 714 Ca 0.04 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1fr0 h GLU 714 Cb 0.70 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1fr0 h GLU 714 CO 0.05 1.05 0.00 0.39 -1.00 0.00 0.00 179.01 179.50 1fr0 n GLU 715 N -4.47 0.05 0.01 2.33 -0.58 -0.90 -1.79 120.64 115.28 1fr0 n GLU 715 Ca -0.11 0.26 -0.01 0.00 -0.42 0.00 0.00 57.16 56.88 1fr0 n GLU 715 Cb 0.57 -1.58 -0.00 0.00 -0.57 0.00 0.00 31.44 29.86 1fr0 n GLU 715 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1fr0 h GLY 716 N 2.70 -0.07 2.00 0.62 0.00 -1.04 -2.71 103.07 104.57 1fr0 h GLY 716 Ca 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 1fr0 h GLY 716 CO 0.00 -0.02 -0.16 1.12 0.00 0.00 0.00 176.54 177.48 1fr0 h HIS 717 N -0.34 0.00 0.08 5.60 2.07 -1.60 -0.16 115.15 120.79 1fr0 h HIS 717 Ca -0.01 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 1fr0 h HIS 717 Cb 0.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.03 1fr0 h HIS 717 CO 0.02 0.16 -0.04 -0.22 -3.07 0.00 0.00 177.93 174.78 1fr0 h LYS 718 N 0.00 -0.10 0.09 5.12 1.63 -1.48 0.19 116.57 122.02 1fr0 h LYS 718 Ca -0.00 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1fr0 h LYS 718 Cb 0.47 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1fr0 h LYS 718 CO 0.02 0.27 -0.04 0.82 -3.45 0.00 0.00 179.45 177.07 1fr0 h ILE 719 N -0.50 0.87 -0.98 2.00 5.03 -1.35 -2.16 117.51 120.42 1fr0 h ILE 719 Ca -0.01 -1.40 0.04 0.00 -0.12 0.00 0.00 64.86 63.37 1fr0 h ILE 719 Cb 0.42 1.56 -0.06 0.00 -3.03 0.00 0.00 36.82 35.71 1fr0 h ILE 719 CO 0.02 0.26 0.64 0.11 -0.68 0.00 0.00 178.15 178.50 1fr0 h LYS 720 N -0.94 1.18 -0.33 2.37 6.56 -1.16 0.15 116.57 124.41 1fr0 h LYS 720 Ca -0.01 -0.07 -0.07 0.00 -1.06 0.00 0.00 60.65 59.44 1fr0 h LYS 720 Cb 0.52 -0.27 -0.02 0.00 -0.57 0.00 0.00 32.23 31.90 1fr0 h LYS 720 CO 0.02 0.78 -0.08 0.78 -2.06 0.00 0.00 179.45 178.89 1fr0 h GLY 721 N 1.22 0.58 0.33 3.86 0.00 -0.70 -2.27 103.07 106.09 1fr0 h GLY 721 Ca 0.40 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 1fr0 h GLY 721 CO -0.13 0.36 -0.13 0.00 0.00 0.00 0.00 176.54 176.64 1fr0 h ALA 722 N 1.41 -0.36 -0.98 3.60 0.00 -0.46 -3.25 119.26 119.22 1fr0 h ALA 722 Ca 0.10 -0.15 0.29 0.00 0.00 0.00 0.00 54.91 55.15 1fr0 h ALA 722 Cb 0.45 0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.24 1fr0 h ALA 722 CO 0.02 -0.37 0.53 0.00 0.00 0.00 0.00 179.25 179.44 1fr0 h ALA 723 N -0.84 1.82 -0.21 0.00 0.00 -0.78 1.40 119.26 120.65 1fr0 h ALA 723 Ca -0.04 0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1fr0 h ALA 723 Cb 0.41 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1fr0 h ALA 723 CO 0.06 -0.47 0.30 0.78 0.00 0.00 0.00 179.25 179.93 1fr0 h GLY 724 N 0.39 0.00 1.95 0.00 0.00 -1.31 0.28 103.07 104.38 1fr0 h GLY 724 Ca 0.68 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.87 1fr0 h GLY 724 CO -0.57 0.00 -0.64 0.23 0.00 0.00 0.00 176.54 175.56 1fr0 h SER 725 N 0.00 0.06 -0.00 0.19 0.87 0.18 -2.39 113.55 112.45 1fr0 h SER 725 Ca 0.10 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1fr0 h SER 725 Cb 0.70 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1fr0 h SER 725 CO -0.00 0.68 0.00 0.52 -0.53 0.00 0.00 176.83 177.50 1fr0 n VAL 726 N -3.79 0.00 0.00 2.23 0.31 0.92 -4.79 118.33 113.21 1fr0 n VAL 726 Ca -0.01 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1fr0 n VAL 726 Cb 0.64 -0.36 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 1fr0 n VAL 726 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fr0 n GLY 727 N 0.92 1.06 3.28 2.92 0.00 -0.90 -4.93 105.19 107.54 1fr0 n GLY 727 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 1fr0 n GLY 727 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fr0 n LEU 728 N 0.00 5.67 0.11 0.99 4.77 -0.56 -2.01 117.00 125.96 1fr0 n LEU 728 Ca 0.00 -4.55 -0.01 0.00 -0.03 0.00 0.00 56.01 51.41 1fr0 n LEU 728 Cb 0.00 -1.57 0.23 0.00 -2.33 0.00 0.00 43.42 39.76 1fr0 n LEU 728 CO 0.00 0.96 0.64 0.08 -1.33 0.00 0.00 177.39 177.73 1fr0 h ARG 729 N 6.68 0.19 0.44 3.23 -0.00 -1.67 -2.77 114.38 120.48 1fr0 h ARG 729 Ca 0.33 -0.09 -0.01 0.00 -0.00 0.00 0.00 59.98 60.21 1fr0 h ARG 729 Cb 0.80 -0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.76 1fr0 h ARG 729 CO 1.35 0.59 -0.29 1.25 -0.00 0.00 0.00 179.97 182.87 1fr0 h HIS 730 N 0.16 -0.76 -0.96 4.08 2.76 -1.60 -2.44 115.15 116.40 1fr0 h HIS 730 Ca 0.01 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.21 1fr0 h HIS 730 Cb 0.83 0.27 -0.06 0.00 1.55 0.00 0.00 27.41 30.00 1fr0 h HIS 730 CO 0.01 -0.44 0.62 -0.07 -1.30 0.00 0.00 177.93 176.76 1fr0 h LEU 731 N -0.70 1.03 -1.14 0.26 -0.00 -1.78 -1.70 115.31 111.27 1fr0 h LEU 731 Ca -0.05 -0.01 0.15 0.00 -0.00 0.00 0.00 57.88 57.97 1fr0 h LEU 731 Cb 0.58 -0.23 -0.08 0.00 -0.00 0.00 0.00 40.66 40.93 1fr0 h LEU 731 CO 0.04 0.70 0.61 -0.61 -0.00 0.00 0.00 178.44 179.18 1fr0 h GLN 732 N 1.20 0.78 0.38 1.13 -0.00 -1.18 -2.21 115.11 115.20 1fr0 h GLN 732 Ca 0.38 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.65 58.97 1fr0 h GLN 732 Cb 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 27.48 27.32 1fr0 h GLN 732 CO -0.13 0.51 -0.18 1.96 0.00 0.00 0.00 178.83 181.00 1fr0 h GLN 733 N 0.80 -0.49 -1.20 1.69 1.08 -0.86 -2.45 115.11 113.68 1fr0 h GLN 733 Ca 0.50 0.03 0.41 0.00 -1.45 0.00 0.00 58.65 58.14 1fr0 h GLN 733 Cb 0.70 0.11 -0.14 0.00 -0.05 0.00 0.00 27.48 28.11 1fr0 h GLN 733 CO -0.26 -0.23 0.74 -0.07 -0.95 0.00 0.00 178.83 178.06 1fr0 h LEU 734 N -1.06 0.31 0.04 1.46 4.07 -1.18 0.31 115.31 119.25 1fr0 h LEU 734 Ca -0.05 0.17 -0.00 0.00 0.08 0.00 0.00 57.88 58.07 1fr0 h LEU 734 Cb 0.48 0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.37 1fr0 h LEU 734 CO 0.08 -0.22 -0.02 1.23 -1.08 0.00 0.00 178.44 178.44 1fr0 h GLY 735 N 0.12 -0.05 -0.92 0.83 0.00 -1.38 -1.46 103.07 100.21 1fr0 h GLY 735 Ca 0.81 0.02 0.40 0.00 0.00 0.00 0.00 47.33 48.56 1fr0 h GLY 735 CO -0.51 -0.02 0.63 1.46 0.00 0.00 0.00 176.54 178.10 1fr0 h GLN 736 N -0.63 0.10 0.00 4.80 1.08 0.13 1.47 115.11 122.06 1fr0 h GLN 736 Ca -0.00 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 1fr0 h GLN 736 Cb 0.57 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 1fr0 h GLN 736 CO 0.01 0.06 -0.92 1.96 -0.95 0.00 0.00 178.83 178.99 1fr0 h GLN 737 N 0.10 0.00 -0.01 1.46 1.08 -1.42 -3.33 115.11 112.99 1fr0 h GLN 737 Ca 0.82 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.98 1fr0 h GLN 737 Cb 2.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.62 1fr0 h GLN 737 CO -0.64 0.07 -0.15 0.97 -0.95 0.00 0.00 178.83 178.12 1fr0 h ILE 738 N 0.00 1.12 -0.30 2.54 2.10 0.32 -1.39 117.51 121.89 1fr0 h ILE 738 Ca -0.03 -0.55 -0.08 0.00 1.08 0.00 0.00 64.86 65.28 1fr0 h ILE 738 Cb 1.12 1.28 -0.04 0.00 -1.09 0.00 0.00 36.82 38.09 1fr0 h ILE 738 CO 0.01 0.16 0.10 0.00 -1.08 0.00 0.00 178.15 177.34 1fr0 n GLN 739 N -4.35 2.26 -2.44 2.19 10.64 -0.96 -4.16 117.38 120.55 1fr0 n GLN 739 Ca -0.02 -1.30 -0.27 0.00 -1.83 0.00 0.00 57.00 53.58 1fr0 n GLN 739 Cb 0.23 -1.71 0.00 0.00 -0.86 0.00 0.00 30.24 27.90 1fr0 n GLN 739 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1fr0 n SER 740 N 0.11 4.74 -2.66 2.61 7.64 -0.52 -4.92 113.62 120.62 1fr0 n SER 740 Ca 0.16 -3.72 -0.07 0.00 1.01 0.00 0.00 58.87 56.25 1fr0 n SER 740 Cb 0.77 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 63.49 1fr0 n SER 740 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1fr0 n PRO 741 N -0.50 0.77 0.00 1.43 -0.04 -1.26 -2.78 135.00 132.63 1fr0 n PRO 741 Ca 0.40 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1fr0 n PRO 741 Cb 0.69 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 1fr0 n PRO 741 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1fr0 n ASP 742 N 3.58 0.88 -4.77 3.54 2.03 -1.26 -4.98 116.55 115.57 1fr0 n ASP 742 Ca 0.17 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 55.08 1fr0 n ASP 742 Cb 0.18 0.16 -0.03 0.00 -0.72 0.00 0.00 41.12 40.71 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1fr0 s LEU 743 N -0.71 4.38 0.53 -2.67 1.02 -1.12 -4.89 118.68 115.22 1fr0 s LEU 743 Ca 0.00 2.43 0.35 0.00 0.02 0.00 0.00 54.13 56.93 1fr0 s LEU 743 Cb 0.00 -3.78 1.56 0.00 0.02 0.00 0.00 46.19 43.98 1fr0 s LEU 743 CO 0.00 -0.47 2.03 1.55 0.02 0.00 0.00 176.35 179.48 1fr0 h PRO 744 N 3.23 0.00 0.00 1.29 0.13 -1.97 -2.35 132.00 132.33 1fr0 h PRO 744 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1fr0 h PRO 744 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1fr0 h PRO 744 CO 0.65 0.00 -1.36 0.00 -0.23 0.00 0.00 178.00 177.06 1fr0 n ALA 745 N -2.04 4.00 0.12 -0.56 0.00 -1.26 -4.18 120.51 116.59 1fr0 n ALA 745 Ca -0.00 -0.56 -0.23 0.00 0.00 0.00 0.00 53.44 52.64 1fr0 n ALA 745 Cb 0.23 -0.75 -0.16 0.00 0.00 0.00 0.00 19.45 18.78 1fr0 n ALA 745 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1fr0 h TRP 746 N 0.00 0.85 0.00 0.00 7.01 -1.78 -1.36 115.95 120.68 1fr0 h TRP 746 Ca 0.00 -0.62 0.00 0.00 2.11 0.00 0.00 58.89 60.38 1fr0 h TRP 746 Cb 0.67 -0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.70 1fr0 h TRP 746 CO 0.00 1.49 0.00 -1.91 -2.79 0.00 0.00 178.44 175.23 1fr0 n GLU 747 N -3.85 0.70 -0.00 2.65 2.13 -1.12 -1.03 120.64 120.12 1fr0 n GLU 747 Ca -0.16 0.01 0.01 0.00 0.66 0.00 0.00 57.16 57.68 1fr0 n GLU 747 Cb 1.02 -1.50 -0.01 0.00 0.27 0.00 0.00 31.44 31.21 1fr0 n GLU 747 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1fr0 n ASP 748 N -1.09 2.76 -0.00 4.31 9.92 -1.21 -4.66 116.55 126.58 1fr0 n ASP 748 Ca 0.18 -0.22 0.03 0.00 -0.53 0.00 0.00 54.79 54.25 1fr0 n ASP 748 Cb 0.13 1.06 -0.03 0.00 -0.64 0.00 0.00 41.12 41.63 1fr0 n ASP 748 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1fr0 n ASN 749 N -1.36 0.75 -0.33 -2.24 6.94 -0.51 -4.61 115.26 113.88 1fr0 n ASN 749 Ca -0.00 -0.54 0.24 0.00 -0.02 0.00 0.00 54.58 54.26 1fr0 n ASN 749 Cb 0.04 1.04 0.48 0.00 -2.36 0.00 0.00 39.78 38.98 1fr0 n ASN 749 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 1fr0 h VAL 750 N 0.00 0.28 -0.20 3.53 2.07 -1.27 0.25 116.25 120.92 1fr0 h VAL 750 Ca 0.00 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1fr0 h VAL 750 Cb 0.15 -0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 29.81 1fr0 h VAL 750 CO 0.00 0.06 -0.46 1.23 0.02 0.00 0.00 177.57 178.41 1fr0 h GLY 751 N 0.31 -1.17 2.00 2.17 0.00 -1.84 0.38 103.07 104.92 1fr0 h GLY 751 Ca 0.74 0.70 -0.00 0.00 0.00 0.00 0.00 47.33 48.77 1fr0 h GLY 751 CO -0.62 -0.25 -0.02 0.83 0.00 0.00 0.00 176.54 176.49 1fr0 h GLU 752 N -0.43 0.00 0.80 4.80 5.08 -1.32 -1.89 114.58 121.62 1fr0 h GLU 752 Ca 0.04 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1fr0 h GLU 752 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1fr0 h GLU 752 CO -0.42 0.02 -0.42 2.35 -1.00 0.00 0.00 179.01 179.54 1fr0 h TRP 753 N 0.00 -1.11 -0.05 4.33 2.91 0.69 0.11 115.95 122.83 1fr0 h TRP 753 Ca -0.00 -0.02 -0.07 0.00 1.13 0.00 0.00 58.89 59.93 1fr0 h TRP 753 Cb 0.05 0.38 -0.01 0.00 -0.51 0.00 0.00 29.16 29.06 1fr0 h TRP 753 CO 0.00 -0.66 -0.29 0.82 -1.03 0.00 0.00 178.44 177.28 1fr0 h ILE 754 N -1.13 1.23 0.34 2.65 2.04 -0.95 -1.58 117.51 120.13 1fr0 h ILE 754 Ca -0.11 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.64 1fr0 h ILE 754 Cb 0.88 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 1fr0 h ILE 754 CO 0.16 0.32 -0.17 -0.08 0.00 0.00 0.00 178.15 178.38 1fr0 h GLU 755 N 0.09 -0.45 0.00 2.37 4.81 -1.05 -1.72 114.58 118.63 1fr0 h GLU 755 Ca 0.01 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1fr0 h GLU 755 Cb 0.56 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 1fr0 h GLU 755 CO 0.04 -0.13 -0.14 1.05 -0.73 0.00 0.00 179.01 179.09 1fr0 h GLU 756 N -0.79 0.00 -0.29 1.92 -0.00 -0.75 -2.51 114.58 112.16 1fr0 h GLU 756 Ca -0.05 0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 59.18 1fr0 h GLU 756 Cb 0.52 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.26 1fr0 h GLU 756 CO 0.08 0.14 -0.32 1.98 -0.00 0.00 0.00 179.01 180.89 1fr0 h MET 757 N 0.00 0.73 0.62 1.06 4.05 -1.12 -3.29 114.93 116.99 1fr0 h MET 757 Ca -0.00 -0.40 -0.03 0.00 -0.28 0.00 0.00 59.70 58.99 1fr0 h MET 757 Cb 0.36 0.02 0.01 0.00 -0.80 0.00 0.00 31.60 31.18 1fr0 h MET 757 CO 0.02 1.02 -0.30 -0.22 0.23 0.00 0.00 176.91 177.66 1fr0 h LYS 758 N 0.48 -0.80 -3.03 0.39 3.64 -0.89 -0.97 116.57 115.39 1fr0 h LYS 758 Ca 0.04 0.05 -0.68 0.00 -1.27 0.00 0.00 60.65 58.80 1fr0 h LYS 758 Cb 0.89 0.18 0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1fr0 h LYS 758 CO 0.08 -0.49 3.76 0.39 -2.27 0.00 0.00 179.45 180.92 1fr0 n GLU 759 N -5.38 3.71 0.00 1.90 4.71 -1.06 -3.65 120.64 120.88 1fr0 n GLU 759 Ca -0.12 -2.29 0.00 0.00 -0.01 0.00 0.00 57.16 54.74 1fr0 n GLU 759 Cb 0.36 -2.81 0.00 0.00 -1.01 0.00 0.00 31.44 27.97 1fr0 n GLU 759 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1fr0 n GLU 760 N 3.60 0.00 -0.18 3.49 2.13 -1.21 -4.92 120.64 123.55 1fr0 n GLU 760 Ca 0.77 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 58.58 1fr0 n GLU 760 Cb 0.24 0.00 0.09 0.00 0.27 0.00 0.00 31.44 32.04 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 -0.41 0.00 0.00 177.13 176.83 1fr0 h TRP 761 N 0.00 0.32 -0.61 4.31 5.08 -1.24 -1.39 115.95 122.43 1fr0 h TRP 761 Ca 0.00 0.03 0.12 0.00 1.08 0.00 0.00 58.89 60.12 1fr0 h TRP 761 Cb 0.00 -0.06 -0.12 0.00 -3.00 0.00 0.00 29.16 25.99 1fr0 h TRP 761 CO 0.00 0.07 -0.15 -0.09 -1.28 0.00 0.00 178.44 176.99 1fr0 h ARG 762 N 0.35 -0.00 -0.71 0.12 2.43 -1.82 0.21 114.38 114.96 1fr0 h ARG 762 Ca 0.28 0.00 0.10 0.00 -0.81 0.00 0.00 59.98 59.55 1fr0 h ARG 762 Cb 0.35 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.82 1fr0 h ARG 762 CO -0.30 -0.00 0.34 1.25 -1.51 0.00 0.00 179.97 179.74 1fr0 h HIS 763 N -0.00 0.59 -0.80 2.20 2.76 -1.63 0.19 115.15 118.46 1fr0 h HIS 763 Ca 0.29 0.03 0.12 0.00 -2.20 0.00 0.00 60.37 58.62 1fr0 h HIS 763 Cb 0.45 -0.16 -0.09 0.00 1.55 0.00 0.00 27.41 29.16 1fr0 h HIS 763 CO -0.50 0.18 0.40 -0.44 -1.30 0.00 0.00 177.93 176.27 1fr0 h ASP 764 N 0.56 0.49 0.02 3.26 3.32 -0.29 -1.80 116.42 121.98 1fr0 h ASP 764 Ca 0.36 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.49 1fr0 h ASP 764 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1fr0 h ASP 764 CO -0.30 0.24 -0.01 0.58 -1.72 0.00 0.00 179.24 178.03 1fr0 h VAL 765 N 0.61 1.50 -0.49 -1.35 2.07 -0.63 -1.54 116.25 116.43 1fr0 h VAL 765 Ca 0.42 -1.68 0.05 0.00 0.82 0.00 0.00 66.70 66.31 1fr0 h VAL 765 Cb 0.54 2.61 -0.07 0.00 -1.52 0.00 0.00 31.29 32.85 1fr0 h VAL 765 CO -0.33 0.42 -0.41 -0.08 0.02 0.00 0.00 177.57 177.20 1fr0 h GLU 766 N -0.76 -0.14 -0.55 1.57 4.81 -0.30 0.18 114.58 119.39 1fr0 h GLU 766 Ca -0.00 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1fr0 h GLU 766 Cb 0.71 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 1fr0 h GLU 766 CO 0.00 -0.09 0.29 0.28 -0.73 0.00 0.00 179.01 178.76 1fr0 h VAL 767 N -0.15 1.19 -0.63 0.32 2.07 -1.46 -2.73 116.25 114.86 1fr0 h VAL 767 Ca 0.08 -0.51 0.12 0.00 0.82 0.00 0.00 66.70 67.22 1fr0 h VAL 767 Cb 0.36 0.52 -0.12 0.00 -1.52 0.00 0.00 31.29 30.53 1fr0 h VAL 767 CO -0.54 0.21 -0.20 0.25 0.02 0.00 0.00 177.57 177.32 1fr0 h LEU 768 N 0.74 -0.71 -0.26 2.57 5.85 0.08 0.37 115.31 123.95 1fr0 h LEU 768 Ca 0.19 0.20 -0.00 0.00 0.84 0.00 0.00 57.88 59.11 1fr0 h LEU 768 Cb 0.08 0.43 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1fr0 h LEU 768 CO -0.03 -0.24 0.15 0.50 -0.34 0.00 0.00 178.44 178.49 1fr0 h LYS 769 N -0.04 0.36 0.00 1.25 3.11 -0.47 -2.17 116.57 118.61 1fr0 h LYS 769 Ca 0.30 -0.04 -0.04 0.00 -2.81 0.00 0.00 60.65 58.06 1fr0 h LYS 769 Cb 0.49 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.64 1fr0 h LYS 769 CO -0.67 0.31 -0.18 0.00 -2.81 0.00 0.00 179.45 176.09 1fr0 h ALA 770 N 1.03 1.63 -0.31 5.00 0.00 -0.84 -2.45 119.26 123.32 1fr0 h ALA 770 Ca 0.09 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1fr0 h ALA 770 Cb 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1fr0 h ALA 770 CO -0.02 0.23 -0.41 2.35 0.00 0.00 0.00 179.25 181.41 1fr0 h TRP 771 N 0.00 0.92 -0.44 0.00 7.01 0.25 -2.93 115.95 120.76 1fr0 h TRP 771 Ca -0.00 -0.28 -0.09 0.00 2.11 0.00 0.00 58.89 60.63 1fr0 h TRP 771 Cb 0.34 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.19 1fr0 h TRP 771 CO 0.00 1.05 -0.07 0.28 -2.79 0.00 0.00 178.44 176.91 1fr0 h VAL 772 N 0.62 1.27 -0.91 2.65 2.07 -0.95 0.94 116.25 121.94 1fr0 h VAL 772 Ca 0.05 -1.16 0.06 0.00 0.82 0.00 0.00 66.70 66.47 1fr0 h VAL 772 Cb 0.96 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1fr0 h VAL 772 CO 0.09 0.40 0.59 0.00 0.02 0.00 0.00 177.57 178.67 1fr0 h ALA 773 N 0.88 1.50 0.00 1.67 0.00 -1.43 -1.08 119.26 120.80 1fr0 h ALA 773 Ca 0.12 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.76 1fr0 h ALA 773 Cb 0.59 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1fr0 h ALA 773 CO 0.04 0.37 -1.65 0.36 0.00 0.00 0.00 179.25 178.37 1fr0 n LYS 774 N -4.48 0.63 0.00 0.00 2.85 -1.10 -3.87 118.16 112.18 1fr0 n LYS 774 Ca 0.14 0.24 0.11 0.00 -1.05 0.00 0.00 58.31 57.74 1fr0 n LYS 774 Cb 0.19 -1.77 0.53 0.00 -0.65 0.00 0.00 35.03 33.32 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1fr0 n ALA 775 N -2.50 2.10 -1.02 0.58 0.00 0.32 -2.73 120.51 117.26 1fr0 n ALA 775 Ca -0.15 -0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.22 1fr0 n ALA 775 Cb 0.97 -1.37 0.31 0.00 0.00 0.00 0.00 19.45 19.36 1fr0 n ALA 775 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1fr0 n THR 776 N -1.39 2.66 -3.84 0.00 5.66 -0.45 -4.89 114.28 112.03 1fr0 n THR 776 Ca 0.08 -1.74 -0.36 0.00 -3.05 0.00 0.00 64.05 58.98 1fr0 n THR 776 Cb 0.22 -0.30 -0.13 0.00 -1.55 0.00 0.00 70.33 68.57 1fr0 n THR 776 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1fr0 s LYS 777 N -2.90 2.94 0.00 1.09 1.02 -1.10 -5.07 119.74 115.71 1fr0 s LYS 777 Ca 0.50 -0.94 0.00 0.00 0.02 0.00 0.00 55.97 55.55 1fr0 s LYS 777 Cb 0.40 -3.23 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 1fr0 s LYS 777 CO 0.12 -0.45 0.00 1.17 -0.92 0.00 0.00 175.35 175.27